Information card for entry 7057824

Structure parameters

• Formula: C60 H52 Cl N12 O8 Pd2 S4
• Calculated formula: C60 H52 Cl N12 O8 Pd2 S4
• Title of publication: Synthesis, characterisation, crystal structures and biological studies of palladium(ii) complexes containing 5-(2-hydroxy-3-methoxy-phenyl)-2,4-dihydro[1,2,4]triazole-3-thione derivatives
• Authors of publication: Shanmugapriya, A.; Dallemer, F.; Prabhakaran, R.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2018
• Journal volume: 42
• Journal issue: 23
• Pages of publication: 18850
• a: 12.8865 ± 0.0001 Å
• b: 13.4398 ± 0.0002 Å
• c: 19.025 ± 0.0003 Å
• α: 74.731 ± 0.001°
• β: 87.455 ± 0.001°
• γ: 84.536 ± 0.001°
• Cell volume: 3163.58 ± 0.07 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0382
• Residual factor for significantly intense reflections: 0.0331
• Weighted residual factors for significantly intense reflections: 0.0827
• Weighted residual factors for all reflections included in the refinement: 0.0871
• Goodness-of-fit parameter for all reflections included in the refinement: 1.064
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No